%chk=000285698.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285698

0 1
O -2.888758 -2.261366 -0.143596
N 2.135687 0.297311 0.496045
N -1.353476 -0.609822 0.116698
C 1.363486 0.056512 -0.773837
C 0.182179 1.059821 -0.901940
C 0.816097 -1.395280 -0.812926
C -0.913192 0.814629 0.178820
C -0.258522 -1.605731 0.271118
C 0.728414 2.497635 -0.843049
C 1.957171 -2.412267 -0.644389
C 2.681552 1.697579 0.541010
C 3.282652 -0.668271 0.618503
C -2.090489 1.793673 -0.014209
C 1.544538 2.723415 0.432795
C 2.774966 -2.117167 0.616318
C -3.383614 1.270061 0.612410
C -2.660506 -1.060097 -0.043099
C -3.781291 -0.041253 -0.060641
H 2.023586 0.197700 -1.671471
H -0.282492 0.896043 -1.905455
H 0.342391 -1.554151 -1.813482
H -0.456328 0.971276 1.195260
H -0.684929 -2.634601 0.207053
H 0.189562 -1.487196 1.284964
H -0.091102 3.235867 -0.908645
H 1.361969 2.682971 -1.732882
H 2.611434 -2.386554 -1.536582
H 1.548059 -3.439824 -0.601914
H 3.437541 1.890040 -0.251268
H 3.197432 1.821120 1.518759
H 3.791218 -0.459317 1.585402
H 4.041432 -0.535550 -0.183291
H -2.259320 1.986068 -1.092469
H -1.821089 2.770970 0.430112
H 1.962853 3.746505 0.449132
H 0.887132 2.642113 1.322006
H 2.152523 -2.291971 1.517672
H 3.631271 -2.812097 0.692904
H -4.193844 2.016053 0.506825
H -3.249715 1.114847 1.701765
H -4.089533 0.126051 -1.113249
H -4.667347 -0.491942 0.434622


%chk=000285698-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285698

0 1
O -2.946359 -2.319497 -0.214026
N 2.161604 0.306413 0.482087
N -1.382820 -0.614881 0.074762
C 1.361260 0.055546 -0.756105
C 0.185747 1.068670 -0.879947
C 0.823858 -1.401118 -0.793302
C -0.939213 0.806443 0.174969
C -0.294139 -1.600025 0.253640
C 0.737104 2.515725 -0.832480
C 1.966180 -2.427165 -0.608294
C 2.695599 1.693807 0.526300
C 3.284725 -0.660462 0.622253
C -2.112824 1.797711 0.007954
C 1.581700 2.749938 0.439442
C 2.798598 -2.118751 0.656230
C -3.409282 1.262108 0.641326
C -2.684256 -1.076930 -0.090768
C -3.808554 -0.037951 -0.079611
H 2.021717 0.201824 -1.657136
H -0.277358 0.896403 -1.874967
H 0.367048 -1.550861 -1.793026
H -0.498397 0.926978 1.187029
H -0.744246 -2.601946 0.158926
H 0.120126 -1.478679 1.273207
H -0.078121 3.256877 -0.911328
H 1.386697 2.667415 -1.719540
H 2.633900 -2.386274 -1.493638
H 1.551908 -3.452684 -0.565288
H 3.417460 1.865626 -0.319085
H 3.264237 1.810936 1.468043
H 3.829131 -0.415204 1.553847
H 4.013640 -0.542939 -0.226343
H -2.292426 1.984150 -1.071125
H -1.827714 2.764102 0.460564
H 2.036027 3.758935 0.418573
H 0.948547 2.694741 1.345075
H 2.197373 -2.284480 1.569048
H 3.673958 -2.793436 0.714536
H -4.218345 2.011826 0.561371
H -3.252418 1.062875 1.719632
H -4.093388 0.178353 -1.128877
H -4.678687 -0.530314 0.387870


